3-[2-(dimethylazaniumyl)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate

Systemtic Name: 3-[2-(dimethylazaniumyl)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate Openeye Name: 3-[2-(dimethylammonio)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate CAS Name: 3-[2-(dimethylammonio)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate IUPAC Name: 3-[2-(dimethylazaniumyl)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate Traditional Name: 3-[2-(dimethylammonio)ethyl]-5-(methylsulfamoylmethyl)-1H-indole-2-carboxylate Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC2=C(C=C1)NC(=C2CC[NH+](C)C)C(=O)[O-]

Isomeric SMILES

CNS(=O)(=O)CC1=CC2=C(C=C1)NC(=C2CC[NH+](C)C)C(=O)[O-]

InChI

InChI=1S/C15H21N3O4S/c1-16-23(21,22)9-10-4-5-13-12(8-10)11(6-7-18(2)3)14(17-13)15(19)20/h4-5,8,16-17H,6-7,9H2,1-3H3,(H,19,20)